2-(hydroxymethyl)heptane-1,7-diol carbonate

Systemtic Name: 2-(hydroxymethyl)heptane-1,7-diol carbonate Openeye Name: 2-(hydroxymethyl)heptane-1,7-diol carbonate CAS Name: 2-(hydroxymethyl)heptane-1,7-diol carbonate IUPAC Name: 2-(hydroxymethyl)heptane-1,7-diol carbonate Traditional Name: 2-methylolheptane-1,7-diol carbonate Formula: C9H18O6-2 MolecularWeight: 222.23562

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Descriptors Computed from Structure

Canonical SMILES:

C(CCC(CO)CO)CCO.C(=O)([O-])[O-]

Isomeric SMILES

C(CCC(CO)CO)CCO.C(=O)([O-])[O-]

InChI

InChI=1S/C8H18O3.CH2O3/c9-5-3-1-2-4-8(6-10)7-11;2-1(3)4/h8-11H,1-7H2;(H2,2,3,4)/p-2